2-Hydroxy-5-methyl-3-hexanone

Base Information

Chemical Name:2-Hydroxy-5-methyl-3-hexanone
CAS No.:246511-74-0
Molecular Formula:C₇H₁₄O₂
Molecular Weight:130.187
Hs Code.:
European Community (EC) Number:607-413-0
UNII:F06LL2B56F
DSSTox Substance ID:DTXSID70947594
Nikkaji Number:J1.532.198I
Wikidata:Q27277464
Mol file:246511-74-0.mol

Synonyms:2-hydroxy-5-methyl-3-hexanone;2-hydroxy-5-methyl-hexan-3-one;FEMA No. 3989, 2-hydroxy-;UNII-F06LL2B56F;F06LL2B56F;2-hydroxy-5-methylhexan-3-one;246511-74-0;SCHEMBL108766;DTXSID70947594;OYUBDGVWESFPBQ-UHFFFAOYSA-N;3-HEXANONE, 2-HYDROXY-5-METHYL-;(+/-)-2-HYDROXY-5-METHYLHEXAN-3-ONE;2-HYDROXY-5-METHYLHEXAN-3-ONE, (+/-)-;Q27277464

Suppliers and Price of 2-Hydroxy-5-methyl-3-hexanone

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 6 raw suppliers

Chemical Property of 2-Hydroxy-5-methyl-3-hexanone

Chemical Property:

Vapor Pressure:0.426mmHg at 25°C
Refractive Index:1.429
Boiling Point:172.206°C at 760 mmHg
Flash Point:63.915°C
Density:0.933g/cm³
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:130.099379685
Heavy Atom Count:9
Complexity:97.1

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)CC(=O)C(C)O

Technology Process of 2-Hydroxy-5-methyl-3-hexanone

There total 7 articles about 2-Hydroxy-5-methyl-3-hexanone which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 13706-86-0
5-methyl-2,3-hexanedione

: 152212-36-7
(R)-3-Hydroxy-2-hexanone

: 246511-74-0
2-hydroxy-5-methyl-3-hexanone

Guidance literature:: With formate dehydrogenase from Candida boidinii; sodium formate; R-selective 2,3-butanediol dehydrogenase from Bacillus clausii DSM 8716^T; NADH; In methanol; at 30 ℃; for 48h; pH=6.8; stereoselective reaction; Enzymatic reaction;
DOI:10.1039/d0ra02066d

Reference yield:

: 623-56-3
5-methyl-3-hexanone

: 246511-74-0
2-hydroxy-5-methyl-3-hexanone

Guidance literature:: Multi-step reaction with 2 steps

1.1: sodium hexamethyldisilazane / hexane / 0.17 h / -78 °C / Inert atmosphere

1.2: -78 - 20 °C / Inert atmosphere

1.3: -25 - 20 °C

2.1: hydrogenchloride / methanol; dichloromethane / 0.5 h / Reflux

With hydrogenchloride; sodium hexamethyldisilazane; In methanol; hexane; dichloromethane;
DOI:10.3184/174751911X556774

Reference yield:

: 623-55-2
(+-)-5-methyl-3-hexanol

: 246511-74-0
2-hydroxy-5-methyl-3-hexanone

Guidance literature:: Multi-step reaction with 3 steps

1.1: silica gel; pyridinium chlorochromate / dichloromethane / 3.5 h / 0 - 20 °C / Molecular sieve; Inert atmosphere

2.1: sodium hexamethyldisilazane / hexane / 0.17 h / -78 °C / Inert atmosphere

2.2: -78 - 20 °C / Inert atmosphere

2.3: -25 - 20 °C

3.1: hydrogenchloride / methanol; dichloromethane / 0.5 h / Reflux

With hydrogenchloride; sodium hexamethyldisilazane; silica gel; pyridinium chlorochromate; In methanol; hexane; dichloromethane;
DOI:10.3184/174751911X556774